1-(5-methylthiophen-3-yl)cyclohexan-1-ol

C11H16OS — CID 65099543

IUPAC1-(5-methylthiophen-3-yl)cyclohexan-1-ol
SMILESCc1cc(C2(O)CCCCC2)cs1
InChIInChI=1S/C11H16OS/c1-9-7-10(8-13-9)11(12)5-3-2-4-6-11/h7-8,12H,2-6H2,1H3
InChIKeyFCYXBRRICFQXJL-UHFFFAOYSA-N
MW196.31 g/mol
LogP3.21
Rot. Bonds1

About 1-(5-methylthiophen-3-yl)cyclohexan-1-ol

1-(5-methylthiophen-3-yl)cyclohexan-1-ol (PubChem CID 65099543) has the molecular formula C11H16OS and a molecular weight of 196.31 g/mol. Its IUPAC name is 1-(5-methylthiophen-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(5-methylthiophen-3-yl)cyclohexan-1-ol
PubChem CID65099543
Molecular FormulaC11H16OS
Molecular Weight196.31 g/mol
Exact Mass196.09
IUPAC Name1-(5-methylthiophen-3-yl)cyclohexan-1-ol
SMILESCc1cc(C2(O)CCCCC2)cs1
InChIInChI=1S/C11H16OS/c1-9-7-10(8-13-9)11(12)5-3-2-4-6-11/h7-8,12H,2-6H2,1H3
InChIKeyFCYXBRRICFQXJL-UHFFFAOYSA-N
XLogP3.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.31
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methylthiophen-3-yl)cyclohexan-1-ol?
The IUPAC name of 1-(5-methylthiophen-3-yl)cyclohexan-1-ol (CID 65099543) is 1-(5-methylthiophen-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 1-(5-methylthiophen-3-yl)cyclohexan-1-ol?
The canonical SMILES for 1-(5-methylthiophen-3-yl)cyclohexan-1-ol is Cc1cc(C2(O)CCCCC2)cs1.
What is the InChIKey of 1-(5-methylthiophen-3-yl)cyclohexan-1-ol?
The InChIKey is FCYXBRRICFQXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OS/c1-9-7-10(8-13-9)11(12)5-3-2-4-6-11/h7-8,12H,2-6H2,1H3.
What are the key properties of 1-(5-methylthiophen-3-yl)cyclohexan-1-ol?
1-(5-methylthiophen-3-yl)cyclohexan-1-ol has a molecular weight of 196.31 g/mol, XLogP of 3.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylthiophen-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 65099543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).